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#1Multiwfn and wavefunction analysis»Electron density cube file from UHF Molden file for alpha spin only?»2022-11-07 16:02:38

SCmwfnQ
Replies: 2

Dear Tian Lu,
Can Multiwfn generate a cube file from alpha spins only (or beta spins only) from a UHF molden file?
I've been using orbkit to do that, but Multiwfn has a lot of advantage!
Thanks very much,
Steve Coy

#2Re:Multiwfn and wavefunction analysis»Missing bond between some atoms in VMD»2022-11-07 15:05:50

Also, VMD Dynamic Bonds can add bonds based on interatomic distances.

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